4-(1-sulfanylhexan-3-yl)benzene-1,2-diol

Systemtic Name: 4-(1-sulfanylhexan-3-yl)benzene-1,2-diol Openeye Name: 4-[1-(2-sulfanylethyl)butyl]benzene-1,2-diol CAS Name: 4-(1-mercaptohexan-3-yl)benzene-1,2-diol IUPAC Name: 4-(1-sulfanylhexan-3-yl)benzene-1,2-diol Traditional Name: 4-[1-(2-mercaptoethyl)butyl]pyrocatechol Formula: C12H18O2S MolecularWeight: 226.33512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCS)C1=CC(=C(C=C1)O)O

Isomeric SMILES

CCCC(CCS)C1=CC(=C(C=C1)O)O

InChI

InChI=1S/C12H18O2S/c1-2-3-9(6-7-15)10-4-5-11(13)12(14)8-10/h4-5,8-9,13-15H,2-3,6-7H2,1H3